Chemical Proteomic Tool for Ligand Mapping of CYP Antitargets: An NMR-Compatible 3D QSAR Descriptor in the Heme-Based Coordinate System. - Huili Yao; Aurora D. Costache; Daniel S. Sem (J. Chem. Inf. Model., 2004)

Synergistic Use of Compound Properties and Docking Scores in Neural Network Modeling of CYP2D6 Binding: Predicting Affinity and Conformational Sampling. - Peter S. Bazeley; Sridevi Prithivi; Craig A. Struble; Richard J. Povinelli; Daniel S. Sem (J. Chem. Inf. Model., 2006)

A Novel Scoring Based Distributed Protein Docking Application to Improve Enrichment. - Prachi Pradeep; Craig A. Struble; Terrence Neumann; Daniel S. Sem; Stephen J. Merrill (IEEE ACM Trans. Comput. Biol. Bioinform., 2015)

Role of Conserved Histidine and Serine in the HCXXXXXRS Motif of Human Dual-Specificity Phosphatase 5. - Ankan Gupta; Jaladhi Brahmbhatt; Raulia Syrlybaeva; Catherine Bodnar; Natalia Bodnar; Robert Bongard; Phani Raj Pokkuluri; Daniel S. Sem; Ramani Ramchandran; Rajendra Rathore; Marat R. Talipov (J. Chem. Inf. Model., 2019)